5-(2-chloranylpropanoylamino)-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: 5-(2-chloranylpropanoylamino)-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-(2-chloropropanoylamino)-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[(2-chloro-1-oxopropyl)amino]-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: 5-(2-chloropropanoylamino)-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-(2-chloropropanoylamino)-N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C27H38ClN5O3 MolecularWeight: 516.07532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)C(C)Cl)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)C(C)Cl)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C27H38ClN5O3/c1-5-31(6-2)14-13-29-27(35)22-19-21(30-26(34)20(3)28)11-12-23(22)32-15-17-33(18-16-32)24-9-7-8-10-25(24)36-4/h7-12,19-20H,5-6,13-18H2,1-4H3,(H,29,35)(H,30,34)