4-azanyl-5-chloranyl-2-ethoxy-N-[1-ethyl-4-(phenylmethyl)-1,4-diazepan-6-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-ethoxy-N-[1-ethyl-4-(phenylmethyl)-1,4-diazepan-6-yl]benzamide Openeye Name: 4-amino-N-(1-benzyl-4-ethyl-1,4-diazepan-6-yl)-5-chloro-2-ethoxy-benzamide CAS Name: 4-amino-5-chloro-2-ethoxy-N-[1-ethyl-4-(phenylmethyl)-1,4-diazepan-6-yl]benzamide IUPAC Name: 4-amino-N-(1-benzyl-4-ethyl-1,4-diazepan-6-yl)-5-chloro-2-ethoxybenzamide Traditional Name: 4-amino-N-(1-benzyl-4-ethyl-1,4-diazepan-6-yl)-5-chloro-2-ethoxy-benzamide Formula: C23H31ClN4O2 MolecularWeight: 430.97084

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC(C1)NC(=O)C2=CC(=C(C=C2OCC)N)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCN1CCN(CC(C1)NC(=O)C2=CC(=C(C=C2OCC)N)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C23H31ClN4O2/c1-3-27-10-11-28(14-17-8-6-5-7-9-17)16-18(15-27)26-23(29)19-12-20(24)21(25)13-22(19)30-4-2/h5-9,12-13,18H,3-4,10-11,14-16,25H2,1-2H3,(H,26,29)