methyl (2S,3S)-2-[[(2S)-2-azanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoate

Systemtic Name: methyl (2S,3S)-2-[[(2S)-2-azanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoate Openeye Name: methyl (2S,3S)-2-[[(2S)-2-amino-4-(4-methoxyphenyl)-4-oxo-butanoyl]amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(2S)-2-amino-4-(4-methoxyphenyl)-1,4-dioxobutyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[[(2S)-2-amino-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[[(2S)-2-amino-4-keto-4-(4-methoxyphenyl)butanoyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C(CC(=O)C1=CC=C(C=C1)OC)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)[C@H](CC(=O)C1=CC=C(C=C1)OC)N

InChI

InChI=1S/C18H26N2O5/c1-5-11(2)16(18(23)25-4)20-17(22)14(19)10-15(21)12-6-8-13(24-3)9-7-12/h6-9,11,14,16H,5,10,19H2,1-4H3,(H,20,22)/t11-,14-,16-/m0/s1