2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]propanamide

Systemtic Name: 2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: 2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: 2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: 2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: 2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-N-p-anisyl-propionamide Formula: C23H36N4O3 MolecularWeight: 416.55694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)OC)N2CCN(CC2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)OC)N2CCN(CC2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C23H36N4O3/c1-19(23(29)24-17-20-7-9-21(30-2)10-8-20)26-15-13-25(14-16-26)18-22(28)27-11-5-3-4-6-12-27/h7-10,19H,3-6,11-18H2,1-2H3,(H,24,29)