methyl 3-[2-(4-ethylpiperazine-1,4-diium-1-yl)ethanoylamino]-4-methoxy-1H-indole-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=C(NC3=C2C(=CC=C3)OC)C(=O)OC

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=C(NC3=C2C(=CC=C3)OC)C(=O)OC

InChI

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