(2-methyl-3-oxidanyl-propyl) 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: (2-methyl-3-oxidanyl-propyl) 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: (3-hydroxy-2-methyl-propyl) 6-benzyloxy-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid (3-hydroxy-2-methylpropyl) ester IUPAC Name: (3-hydroxy-2-methylpropyl) 4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-benzoxy-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid (3-hydroxy-2-methyl-propyl) ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)COC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(CO)COC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5/c1-16(12-28)13-32-25(29)24-20(15-30-2)23-19-10-18(31-14-17-6-4-3-5-7-17)8-9-21(19)27-22(23)11-26-24/h3-11,16,27-28H,12-15H2,1-2H3