propan-2-yl 4,9-bis(methoxymethyl)-6-phenylmethoxy-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: propan-2-yl 4,9-bis(methoxymethyl)-6-phenylmethoxy-pyrido[3,4-b]indole-3-carboxylate Openeye Name: isopropyl 6-benzyloxy-4,9-bis(methoxymethyl)pyrido[3,4-b]indole-3-carboxylate CAS Name: 4,9-bis(methoxymethyl)-6-phenylmethoxy-3-pyrido[3,4-b]indolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4,9-bis(methoxymethyl)-6-phenylmethoxypyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-benzoxy-4,9-bis(methoxymethyl)-$b-carboline-3-carboxylic acid isopropyl ester Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2COC)C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2COC)C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O5/c1-17(2)33-26(29)25-21(15-30-3)24-20-12-19(32-14-18-8-6-5-7-9-18)10-11-22(20)28(16-31-4)23(24)13-27-25/h5-13,17H,14-16H2,1-4H3