4-methoxy-N-[(Z)-[2-oxidanylidene-1-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]indol-3-ylidene]amino]benzamide

Systemtic Name: 4-methoxy-N-[(Z)-[2-oxidanylidene-1-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]indol-3-ylidene]amino]benzamide Openeye Name: 4-methoxy-N-[(Z)-[2-oxo-1-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]indolin-3-ylidene]amino]benzamide CAS Name: 4-methoxy-N-[(Z)-[2-oxo-1-[[(2S)-2-(3-pyridinyl)-1-piperidin-1-iumyl]methyl]-3-indolylidene]amino]benzamide IUPAC Name: 4-methoxy-N-[(Z)-[2-oxo-1-[[(2S)-2-pyridin-3-ylpiperidin-1-ium-1-yl]methyl]indol-3-ylidene]amino]benzamide Traditional Name: N-[(Z)-[2-keto-1-[[(2S)-2-(3-pyridyl)piperidin-1-ium-1-yl]methyl]indolin-3-ylidene]amino]-4-methoxy-benzamide Formula: C27H28N5O3+ MolecularWeight: 470.54292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NN=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCCCC4C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N/N=C\2/C3=CC=CC=C3N(C2=O)C[NH+]4CCCC[C@H]4C5=CN=CC=C5

InChI

InChI=1S/C27H27N5O3/c1-35-21-13-11-19(12-14-21)26(33)30-29-25-22-8-2-3-10-24(22)32(27(25)34)18-31-16-5-4-9-23(31)20-7-6-15-28-17-20/h2-3,6-8,10-15,17,23H,4-5,9,16,18H2,1H3,(H,30,33)/p+1/b29-25-/t23-/m0/s1