(2S)-2-azanyl-5-[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[2-[[3-carbethoxy-5-carbomethoxy-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]methoxy]ethylamino]-5-keto-valeric acid Formula: C25H32ClN3O8 MolecularWeight: 537.98988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C25H32ClN3O8/c1-4-37-25(34)22-18(13-36-12-11-28-19(30)10-9-17(27)23(31)32)29-14(2)20(24(33)35-3)21(22)15-7-5-6-8-16(15)26/h5-8,17,21,29H,4,9-13,27H2,1-3H3,(H,28,30)(H,31,32)/t17-,21?/m0/s1