methyl (2S)-2-[[(2S)-2-azanyl-5-(2-methoxyphenyl)pent-4-ynoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-azanyl-5-(2-methoxyphenyl)pent-4-ynoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(2S)-2-amino-5-(2-methoxyphenyl)pent-4-ynoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2S)-2-amino-5-(2-methoxyphenyl)-1-oxopent-4-ynyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-amino-5-(2-methoxyphenyl)pent-4-ynoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2S)-2-amino-5-(2-methoxyphenyl)pent-4-ynoyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C(CC#CC1=CC=CC=C1OC)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)[C@H](CC#CC1=CC=CC=C1OC)N

InChI

InChI=1S/C19H26N2O4/c1-13(2)12-16(19(23)25-4)21-18(22)15(20)10-7-9-14-8-5-6-11-17(14)24-3/h5-6,8,11,13,15-16H,10,12,20H2,1-4H3,(H,21,22)/t15-,16-/m0/s1