methyl 2-[4,4-bis(azanyl)butanoyl-methyl-amino]-2-methyl-4-oxidanylidene-3-phenyl-4-pyrrolidin-2-yl-butanoate

Systemtic Name: methyl 2-[4,4-bis(azanyl)butanoyl-methyl-amino]-2-methyl-4-oxidanylidene-3-phenyl-4-pyrrolidin-2-yl-butanoate Openeye Name: methyl 2-[4,4-diaminobutanoyl(methyl)amino]-2-methyl-4-oxo-3-phenyl-4-pyrrolidin-2-yl-butanoate CAS Name: 2-[(4,4-diamino-1-oxobutyl)-methylamino]-2-methyl-4-oxo-3-phenyl-4-(2-pyrrolidinyl)butanoic acid methyl ester IUPAC Name: methyl 2-[4,4-diaminobutanoyl(methyl)amino]-2-methyl-4-oxo-3-phenyl-4-pyrrolidin-2-ylbutanoate Traditional Name: 2-[4,4-diaminobutanoyl(methyl)amino]-4-keto-2-methyl-3-phenyl-4-pyrrolidin-2-yl-butyric acid methyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)C(=O)C2CCCN2)(C(=O)OC)N(C)C(=O)CCC(N)N

Isomeric SMILES

CC(C(C1=CC=CC=C1)C(=O)C2CCCN2)(C(=O)OC)N(C)C(=O)CCC(N)N

InChI

InChI=1S/C21H32N4O4/c1-21(20(28)29-3,25(2)17(26)12-11-16(22)23)18(14-8-5-4-6-9-14)19(27)15-10-7-13-24-15/h4-6,8-9,15-16,18,24H,7,10-13,22-23H2,1-3H3