(E)-N-[2-(azepan-1-yl)propyl]-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(azepan-1-yl)propyl]-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-[2-(azepan-1-yl)propyl]-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-[2-(1-azepanyl)propyl]-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(azepan-1-yl)propyl]-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(azepan-1-yl)propyl]-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)acrylamide Formula: C21H31ClN2O3 MolecularWeight: 394.93544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)NCC(C)N2CCCCCC2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)NCC(C)N2CCCCCC2)OC

InChI

InChI=1S/C21H31ClN2O3/c1-4-27-21-18(22)13-17(14-19(21)26-3)9-10-20(25)23-15-16(2)24-11-7-5-6-8-12-24/h9-10,13-14,16H,4-8,11-12,15H2,1-3H3,(H,23,25)/b10-9+