4-(3-methanoylindol-1-yl)-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-(3-methanoylindol-1-yl)-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-(3-formylindol-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)chromane-6-carbonitrile CAS Name: 4-(3-formyl-1-indolyl)-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-(3-formylindol-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-(3-formylindol-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)chroman-6-carbonitrile Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C4=CC=CC=C43)C=O)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C4=CC=CC=C43)C=O)O)COC

InChI

InChI=1S/C23H22N2O5/c1-28-13-23(14-29-2)22(27)21(18-9-15(10-24)7-8-20(18)30-23)25-11-16(12-26)17-5-3-4-6-19(17)25/h3-9,11-12,21-22,27H,13-14H2,1-2H3