9-oxidanylidene-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: 9-oxidanylidene-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: 9-oxo-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C24H26N5O2+ MolecularWeight: 416.49554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)NN=C4CC[NH+](CC4)CC5=CC=CC=C5)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)NN=C4CC[NH+](CC4)CC5=CC=CC=C5)C(=O)N2C1

InChI

InChI=1S/C24H25N5O2/c30-23(18-8-9-20-21(15-18)25-22-7-4-12-29(22)24(20)31)27-26-19-10-13-28(14-11-19)16-17-5-2-1-3-6-17/h1-3,5-6,8-9,15H,4,7,10-14,16H2,(H,27,30)/p+1