3-[[4-(aminomethyl)phenyl]-cyclopropyl-amino]azepan-2-one

Systemtic Name: 3-[[4-(aminomethyl)phenyl]-cyclopropyl-amino]azepan-2-one Openeye Name: 3-[4-(aminomethyl)-N-cyclopropyl-anilino]azepan-2-one CAS Name: 3-[4-(aminomethyl)-N-cyclopropylanilino]-2-azepanone IUPAC Name: 3-[4-(aminomethyl)-N-cyclopropylanilino]azepan-2-one Traditional Name: 3-[4-(aminomethyl)-N-cyclopropyl-anilino]azepan-2-one Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(C2CC2)C3=CC=C(C=C3)CN

Isomeric SMILES

C1CCNC(=O)C(C1)N(C2CC2)C3=CC=C(C=C3)CN

InChI

InChI=1S/C16H23N3O/c17-11-12-4-6-13(7-5-12)19(14-8-9-14)15-3-1-2-10-18-16(15)20/h4-7,14-15H,1-3,8-11,17H2,(H,18,20)