2-chloranyl-N-[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 2-chloro-N-[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-3-oxo-propyl]benzamide CAS Name: 2-chloro-N-[3-[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-3-oxopropyl]benzamide IUPAC Name: 2-chloro-N-[3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-3-oxopropyl]benzamide Traditional Name: 2-chloro-N-[3-keto-3-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]propyl]benzamide Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)CCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)CCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H27ClN2O3/c1-29-18-12-10-17(11-13-18)21-9-3-2-6-16-26(21)22(27)14-15-25-23(28)19-7-4-5-8-20(19)24/h4-5,7-8,10-13,21H,2-3,6,9,14-16H2,1H3,(H,25,28)/t21-/m1/s1