4-chloranyl-N-[3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]benzamide Openeye Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-propyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[3-oxo-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]benzamide IUPAC Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxopropyl]-4-chlorobenzamide Traditional Name: N-[3-(4-benzyl-1,4-diazepan-1-yl)-3-keto-propyl]-4-chloro-benzamide Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H26ClN3O2/c23-20-9-7-19(8-10-20)22(28)24-12-11-21(27)26-14-4-13-25(15-16-26)17-18-5-2-1-3-6-18/h1-3,5-10H,4,11-17H2,(H,24,28)