methyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]benzoate CAS Name: 4-[[4-(1-azepanyl)anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]benzoate Traditional Name: 4-[[4-(azepan-1-yl)phenyl]carbamoyl]benzoic acid methyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H24N2O3/c1-26-21(25)17-8-6-16(7-9-17)20(24)22-18-10-12-19(13-11-18)23-14-4-2-3-5-15-23/h6-13H,2-5,14-15H2,1H3,(H,22,24)