methyl 1-(diazidomethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl]pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-(diazidomethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl]pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-(diazidomethyl)-9-[(E)-2-methoxycarbonyl-3-phenyl-allyl]pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(diazidomethyl)-9-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl]-3-pyrido[3,4-b]indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(diazidomethyl)-9-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl]pyrido[3,4-b]indole-3-carboxylate Traditional Name: 9-[(E)-2-carbomethoxy-3-phenyl-allyl]-1-(diazidomethyl)-$b-carboline-3-carboxylic acid methyl ester Formula: C25H20N8O4 MolecularWeight: 496.4775

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2CC(=CC4=CC=CC=C4)C(=O)OC)C(N=[N+]=[N-])N=[N+]=[N-]

Isomeric SMILES

COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2C/C(=C\C4=CC=CC=C4)/C(=O)OC)C(N=[N+]=[N-])N=[N+]=[N-]

InChI

InChI=1S/C25H20N8O4/c1-36-24(34)16(12-15-8-4-3-5-9-15)14-33-20-11-7-6-10-17(20)18-13-19(25(35)37-2)28-21(22(18)33)23(29-31-26)30-32-27/h3-13,23H,14H2,1-2H3/b16-12+