N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-11-oxidanylidene-pyrido[2,1-b]quinazoline-6-carboxamide

Systemtic Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-11-oxidanylidene-pyrido[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-11-oxo-pyrido[2,1-b]quinazoline-6-carboxamide CAS Name: N-[3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]propyl]-11-oxo-6-pyrido[2,1-b]quinazolinecarboxamide IUPAC Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-11-oxopyrido[2,1-b]quinazoline-6-carboxamide Traditional Name: N-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-11-keto-pyrido[2,1-b]quinazoline-6-carboxamide Formula: C26H27ClN5O2+ MolecularWeight: 476.97788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=O)C2=CC=CN3C2=NC4=CC=CC=C4C3=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=O)C2=CC=CN3C2=NC4=CC=CC=C4C3=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H26ClN5O2/c27-19-6-3-7-20(18-19)31-16-14-30(15-17-31)12-5-11-28-25(33)22-9-4-13-32-24(22)29-23-10-2-1-8-21(23)26(32)34/h1-4,6-10,13,18H,5,11-12,14-17H2,(H,28,33)/p+1