3-isothiocyanato-4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole

Systemtic Name: 3-isothiocyanato-4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole Openeye Name: 6-benzyloxy-3-isothiocyanato-4-(methoxymethyl)-9H-pyrido[3,4-b]indole CAS Name: 3-isothiocyanato-4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole IUPAC Name: 3-isothiocyanato-4-(methoxymethyl)-6-phenylmethoxy-9H-pyrido[3,4-b]indole Traditional Name: 6-benzoxy-3-isothiocyanato-4-(methoxymethyl)-9H-$b-carboline Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C2C3=C(C=CC(=C3)OCC4=CC=CC=C4)NC2=CN=C1N=C=S

Isomeric SMILES

COCC1=C2C3=C(C=CC(=C3)OCC4=CC=CC=C4)NC2=CN=C1N=C=S

InChI

InChI=1S/C21H17N3O2S/c1-25-12-17-20-16-9-15(26-11-14-5-3-2-4-6-14)7-8-18(16)24-19(20)10-22-21(17)23-13-27/h2-10,24H,11-12H2,1H3