ethyl 5-methoxy-3-[2-(4-methylpiperazine-1,4-diium-1-yl)ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-methoxy-3-[2-(4-methylpiperazine-1,4-diium-1-yl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-methoxy-3-[[2-(4-methylpiperazine-1,4-diium-1-yl)acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-[[2-(4-methyl-1-piperazine-1,4-diiumyl)-1-oxoethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-3-[[2-(4-methylpiperazine-1,4-diium-1-yl)acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-methoxy-3-[[2-(4-methylpiperazine-1,4-diium-1-yl)acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C19H28N4O4+2 MolecularWeight: 376.45002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C19H26N4O4/c1-4-27-19(25)18-17(14-11-13(26-3)5-6-15(14)20-18)21-16(24)12-23-9-7-22(2)8-10-23/h5-6,11,20H,4,7-10,12H2,1-3H3,(H,21,24)/p+2