heptyl 2-azanyl-4-(furan-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: heptyl 2-azanyl-4-(furan-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: heptyl 2-amino-4-(2-furyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-(2-furanyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid heptyl ester IUPAC Name: heptyl 2-amino-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-4-(2-furyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carboxylic acid heptyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(OC2=C(C1C3=CC=CO3)C(=O)CCC2)N

Isomeric SMILES

CCCCCCCOC(=O)C1=C(OC2=C(C1C3=CC=CO3)C(=O)CCC2)N

InChI

InChI=1S/C21H27NO5/c1-2-3-4-5-6-12-26-21(24)19-18(15-11-8-13-25-15)17-14(23)9-7-10-16(17)27-20(19)22/h8,11,13,18H,2-7,9-10,12,22H2,1H3