methyl 3-[2-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]ethanoylamino]-5-methyl-1H-indole-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CC[NH+](CC3)CCO)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CC[NH+](CC3)CCO)C(=O)OC

InChI

InChI=1S/C19H26N4O4/c1-13-3-4-15-14(11-13)17(18(20-15)19(26)27-2)21-16(25)12-23-7-5-22(6-8-23)9-10-24/h3-4,11,20,24H,5-10,12H2,1-2H3,(H,21,25)/p+2