methyl 2-[[2-[(2-azanyl-4-methyl-pentanoyl)-ethanoyl-amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-[(2-azanyl-4-methyl-pentanoyl)-ethanoyl-amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-[acetyl-(2-amino-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-[acetyl-(2-amino-4-methyl-1-oxopentyl)amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[acetyl-(2-amino-4-methylpentanoyl)amino]-3-methylbutanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[acetyl-(2-amino-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)OC)C(=O)C)N

Isomeric SMILES

CC(C)CC(C(=O)N(C(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)OC)C(=O)C)N

InChI

InChI=1S/C23H35N3O5/c1-14(2)12-18(24)22(29)26(16(5)27)20(15(3)4)21(28)25-19(23(30)31-6)13-17-10-8-7-9-11-17/h7-11,14-15,18-20H,12-13,24H2,1-6H3,(H,25,28)