dimethyl 1-(3-azanylpropyl)-5-methyl-indole-2,3-dicarboxylate; hydron; chloride

Systemtic Name: dimethyl 1-(3-azanylpropyl)-5-methyl-indole-2,3-dicarboxylate; hydron; chloride Openeye Name: dimethyl 1-(3-aminopropyl)-5-methyl-indole-2,3-dicarboxylate; hydron; chloride CAS Name: 1-(3-aminopropyl)-5-methylindole-2,3-dicarboxylic acid dimethyl ester; hydron; chloride IUPAC Name: dimethyl 1-(3-aminopropyl)-5-methylindole-2,3-dicarboxylate; hydron; chloride Traditional Name: 1-(3-aminopropyl)-5-methyl-indole-2,3-dicarboxylic acid dimethyl ester; hydron; chloride Formula: C16H21ClN2O4 MolecularWeight: 340.80194

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Descriptors Computed from Structure

Canonical SMILES:

[H+].CC1=CC2=C(C=C1)N(C(=C2C(=O)OC)C(=O)OC)CCCN.[Cl-]

Isomeric SMILES

[H+].CC1=CC2=C(C=C1)N(C(=C2C(=O)OC)C(=O)OC)CCCN.[Cl-]

InChI

InChI=1S/C16H20N2O4.ClH/c1-10-5-6-12-11(9-10)13(15(19)21-2)14(16(20)22-3)18(12)8-4-7-17;/h5-6,9H,4,7-8,17H2,1-3H3;1H