(phenylmethyl) N-[2-azanyl-6-methyl-1,3-bis(oxidanylidene)-1-(3-pyridin-2-ylphenyl)heptan-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[2-azanyl-6-methyl-1,3-bis(oxidanylidene)-1-(3-pyridin-2-ylphenyl)heptan-4-yl]carbamate Openeye Name: benzyl N-[3-amino-1-isobutyl-2,4-dioxo-4-[3-(2-pyridyl)phenyl]butyl]carbamate CAS Name: N-[2-amino-6-methyl-1,3-dioxo-1-[3-(2-pyridinyl)phenyl]heptan-4-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-amino-6-methyl-1,3-dioxo-1-(3-pyridin-2-ylphenyl)heptan-4-yl]carbamate Traditional Name: N-[3-amino-1-isobutyl-2,4-diketo-4-[3-(2-pyridyl)phenyl]butyl]carbamic acid benzyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C(=O)C1=CC=CC(=C1)C2=CC=CC=N2)N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)C(C(=O)C1=CC=CC(=C1)C2=CC=CC=N2)N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O4/c1-18(2)15-23(30-27(33)34-17-19-9-4-3-5-10-19)26(32)24(28)25(31)21-12-8-11-20(16-21)22-13-6-7-14-29-22/h3-14,16,18,23-24H,15,17,28H2,1-2H3,(H,30,33)