4-azanyl-N-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-chloranyl-2-methoxy-benzamide; (Z)-but-2-enedioic acid

Systemtic Name: 4-azanyl-N-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-chloranyl-2-methoxy-benzamide; (Z)-but-2-enedioic acid Openeye Name: 4-amino-N-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-chloro-2-methoxy-benzamide; maleic acid CAS Name: 4-amino-N-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-5-chloro-2-methoxybenzamide; (Z)-2-butenedioic acid IUPAC Name: 4-amino-N-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-chloro-2-methoxybenzamide; (Z)-but-2-enedioic acid Traditional Name: 4-amino-5-chloro-2-methoxy-N-(4-piperonylpiperazino)benzamide; maleic acid Formula: C24H27ClN4O8 MolecularWeight: 534.94618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl)N.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C20H23ClN4O4.C4H4O4/c1-27-18-10-16(22)15(21)9-14(18)20(26)23-25-6-4-24(5-7-25)11-13-2-3-17-19(8-13)29-12-28-17;5-3(6)1-2-4(7)8/h2-3,8-10H,4-7,11-12,22H2,1H3,(H,23,26);1-2H,(H,5,6)(H,7,8)/b;2-1-