N-[3-azanyl-1-(4-chlorophenyl)propyl]-3-cyclopenta-1,4-dien-1-yl-benzamide

Systemtic Name: N-[3-azanyl-1-(4-chlorophenyl)propyl]-3-cyclopenta-1,4-dien-1-yl-benzamide Openeye Name: N-[3-amino-1-(4-chlorophenyl)propyl]-3-cyclopenta-1,4-dien-1-yl-benzamide CAS Name: N-[3-amino-1-(4-chlorophenyl)propyl]-3-(1-cyclopenta-1,4-dienyl)benzamide IUPAC Name: N-[3-amino-1-(4-chlorophenyl)propyl]-3-cyclopenta-1,4-dien-1-ylbenzamide Traditional Name: N-[3-amino-1-(4-chlorophenyl)propyl]-3-cyclopenta-1,4-dien-1-yl-benzamide Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=C1)C2=CC(=CC=C2)C(=O)NC(CCN)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C=CC(=C1)C2=CC(=CC=C2)C(=O)NC(CCN)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O/c22-19-10-8-16(9-11-19)20(12-13-23)24-21(25)18-7-3-6-17(14-18)15-4-1-2-5-15/h1,3-11,14,20H,2,12-13,23H2,(H,24,25)