methyl (3S)-3-[[(3S)-3-azanyl-4-phenyl-butanoyl]-prop-2-enyl-amino]-4-phenyl-butanoate

Systemtic Name: methyl (3S)-3-[[(3S)-3-azanyl-4-phenyl-butanoyl]-prop-2-enyl-amino]-4-phenyl-butanoate Openeye Name: methyl (3S)-3-[allyl-[(3S)-3-amino-4-phenyl-butanoyl]amino]-4-phenyl-butanoate CAS Name: (3S)-3-[[(3S)-3-amino-1-oxo-4-phenylbutyl]-prop-2-enylamino]-4-phenylbutanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[(3S)-3-amino-4-phenylbutanoyl]-prop-2-enylamino]-4-phenylbutanoate Traditional Name: (3S)-3-[allyl-[(3S)-3-amino-4-phenyl-butanoyl]amino]-4-phenyl-butyric acid methyl ester Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC1=CC=CC=C1)N(CC=C)C(=O)CC(CC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)C[C@H](CC1=CC=CC=C1)N(CC=C)C(=O)C[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C24H30N2O3/c1-3-14-26(23(27)17-21(25)15-19-10-6-4-7-11-19)22(18-24(28)29-2)16-20-12-8-5-9-13-20/h3-13,21-22H,1,14-18,25H2,2H3/t21-,22-/m0/s1