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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O5/c1-25(2,29)15-32-24(28)23-19(14-30-3)22-18-11-17(31-13-16-7-5-4-6-8-16)9-10-20(18)27-21(22)12-26-23/h4-12,27,29H,13-15H2,1-3H3