ethyl 8-azanyl-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenzo[g]indazole-3-carboxylate

Systemtic Name: ethyl 8-azanyl-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenzo[g]indazole-3-carboxylate Openeye Name: ethyl 8-amino-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenzo[g]indazole-3-carboxylate CAS Name: 8-amino-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenzo[g]indazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-amino-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenzo[g]indazole-3-carboxylate Traditional Name: 8-amino-1-(1,3-benzodioxol-5-yl)-4,5-dihydrobenz[g]indazole-3-carboxylic acid ethyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CCC3=C2C=C(C=C3)N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CCC3=C2C=C(C=C3)N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H19N3O4/c1-2-26-21(25)19-15-7-4-12-3-5-13(22)9-16(12)20(15)24(23-19)14-6-8-17-18(10-14)28-11-27-17/h3,5-6,8-10H,2,4,7,11,22H2,1H3