N-[(Z)-[1-(azepan-1-ium-1-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,4-dimethoxy-benzamide

Systemtic Name: N-[(Z)-[1-(azepan-1-ium-1-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,4-dimethoxy-benzamide Openeye Name: N-[(Z)-[1-(azepan-1-ium-1-ylmethyl)-2-oxo-indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide CAS Name: N-[(Z)-[1-(1-azepan-1-iumylmethyl)-2-oxo-3-indolylidene]amino]-3,4-dimethoxybenzamide IUPAC Name: N-[(Z)-[1-(azepan-1-ium-1-ylmethyl)-2-oxoindol-3-ylidene]amino]-3,4-dimethoxybenzamide Traditional Name: N-[(Z)-[1-(azepan-1-ium-1-ylmethyl)-2-keto-indolin-3-ylidene]amino]-3,4-dimethoxy-benzamide Formula: C24H29N4O4+ MolecularWeight: 437.51146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NN=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N/N=C\2/C3=CC=CC=C3N(C2=O)C[NH+]4CCCCCC4)OC

InChI

InChI=1S/C24H28N4O4/c1-31-20-12-11-17(15-21(20)32-2)23(29)26-25-22-18-9-5-6-10-19(18)28(24(22)30)16-27-13-7-3-4-8-14-27/h5-6,9-12,15H,3-4,7-8,13-14,16H2,1-2H3,(H,26,29)/p+1/b25-22-