ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate

Systemtic Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Openeye Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate CAS Name: 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)-1-piperazinyl]butyl]-1H-indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)piperazin-1-yl]butyl]-1H-indole-5-carboxylate Traditional Name: 3-[4-[4-(2,3-dihydro-1,4-benzodioxin-3-yl)piperazino]butyl]-1H-indole-5-carboxylic acid ethyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4COC5=CC=CC=C5O4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC=C2CCCCN3CCN(CC3)C4COC5=CC=CC=C5O4

InChI

InChI=1S/C27H33N3O4/c1-2-32-27(31)20-10-11-23-22(17-20)21(18-28-23)7-5-6-12-29-13-15-30(16-14-29)26-19-33-24-8-3-4-9-25(24)34-26/h3-4,8-11,17-18,26,28H,2,5-7,12-16,19H2,1H3