[1-[(4-methylphenyl)carbamoyl]-2-oxidanylidene-azepan-3-yl]carbamic acid

Systemtic Name: [1-[(4-methylphenyl)carbamoyl]-2-oxidanylidene-azepan-3-yl]carbamic acid Openeye Name: [2-oxo-1-(p-tolylcarbamoyl)azepan-3-yl]carbamic acid CAS Name: [1-[(4-methylanilino)-oxomethyl]-2-oxo-3-azepanyl]carbamic acid IUPAC Name: [1-[(4-methylphenyl)carbamoyl]-2-oxoazepan-3-yl]carbamic acid Traditional Name: [2-keto-1-(p-tolylcarbamoyl)azepan-3-yl]carbamic acid Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCCCC(C2=O)NC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCCCC(C2=O)NC(=O)O

InChI

InChI=1S/C15H19N3O4/c1-10-5-7-11(8-6-10)16-14(20)18-9-3-2-4-12(13(18)19)17-15(21)22/h5-8,12,17H,2-4,9H2,1H3,(H,16,20)(H,21,22)