ethyl 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]-3,4-dihydro-2H-chromene-2-carboxylate

Systemtic Name: ethyl 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]-3,4-dihydro-2H-chromene-2-carboxylate Openeye Name: ethyl 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]chromane-2-carboxylate CAS Name: 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]-3,4-dihydro-2H-chromene-2-carboxylate Traditional Name: 7-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]ethoxy]chroman-2-carboxylic acid ethyl ester Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC2=C(O1)C=C(C=C2)OCCNCCCCC3=CNC4=C3C=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)C1CCC2=C(O1)C=C(C=C2)OCCNCCCCC3=CNC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C27H31N3O4/c1-2-32-27(31)25-11-8-20-7-9-22(16-26(20)34-25)33-14-13-29-12-4-3-5-21-18-30-24-10-6-19(17-28)15-23(21)24/h6-7,9-10,15-16,18,25,29-30H,2-5,8,11-14H2,1H3