(Z)-but-2-enedioic acid; methyl 3-methoxy-1-(3-piperidin-1-ylpropyl)indole-2-carboxylate

Systemtic Name: (Z)-but-2-enedioic acid; methyl 3-methoxy-1-(3-piperidin-1-ylpropyl)indole-2-carboxylate Openeye Name: maleic acid; methyl 3-methoxy-1-[3-(1-piperidyl)propyl]indole-2-carboxylate CAS Name: (Z)-2-butenedioic acid; 3-methoxy-1-[3-(1-piperidinyl)propyl]-2-indolecarboxylic acid methyl ester IUPAC Name: (Z)-but-2-enedioic acid; methyl 3-methoxy-1-(3-piperidin-1-ylpropyl)indole-2-carboxylate Traditional Name: maleic acid; 3-methoxy-1-(3-piperidinopropyl)indole-2-carboxylic acid methyl ester Formula: C23H30N2O7 MolecularWeight: 446.4935

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N(C2=CC=CC=C21)CCCN3CCCCC3)C(=O)OC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

COC1=C(N(C2=CC=CC=C21)CCCN3CCCCC3)C(=O)OC.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C19H26N2O3.C4H4O4/c1-23-18-15-9-4-5-10-16(15)21(17(18)19(22)24-2)14-8-13-20-11-6-3-7-12-20;5-3(6)1-2-4(7)8/h4-5,9-10H,3,6-8,11-14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-