4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[4-(azepan-1-yl)phenyl]-3-methoxy-benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-N-[4-(azepan-1-yl)phenyl]-3-methoxy-benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-N-[4-(azepan-1-yl)phenyl]-3-methoxy-benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-N-[4-(1-azepanyl)phenyl]-3-methoxybenzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-N-[4-(azepan-1-yl)phenyl]-3-methoxybenzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-N-[4-(azepan-1-yl)phenyl]-3-methoxy-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3)OCC(=O)N

InChI

InChI=1S/C22H27N3O4/c1-28-20-14-16(6-11-19(20)29-15-21(23)26)22(27)24-17-7-9-18(10-8-17)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13,15H2,1H3,(H2,23,26)(H,24,27)