methyl (2R)-2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]-2-oxidanylidene-azepan-1-yl]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]-2-oxidanylidene-azepan-1-yl]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[(3S)-3-[[(1S)-1-ethoxycarbonyl-3-phenyl-propyl]amino]-2-oxo-azepan-1-yl]-4-methyl-pentanoate CAS Name: (2R)-2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-2-oxo-1-azepanyl]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-2-oxoazepan-1-yl]-4-methylpentanoate Traditional Name: (2R)-2-[(3S)-3-[[(1S)-1-carbethoxy-3-phenyl-propyl]amino]-2-keto-azepan-1-yl]-4-methyl-valeric acid methyl ester Formula: C25H38N2O5 MolecularWeight: 446.57962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC2CCCCN(C2=O)C(CC(C)C)C(=O)OC

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H]2CCCCN(C2=O)[C@H](CC(C)C)C(=O)OC

InChI

InChI=1S/C25H38N2O5/c1-5-32-24(29)21(15-14-19-11-7-6-8-12-19)26-20-13-9-10-16-27(23(20)28)22(17-18(2)3)25(30)31-4/h6-8,11-12,18,20-22,26H,5,9-10,13-17H2,1-4H3/t20-,21-,22+/m0/s1