2-hexyl-3-[(2-methoxy-5-nitro-phenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

Systemtic Name: 2-hexyl-3-[(2-methoxy-5-nitro-phenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 2-hexyl-3-[(2-methoxy-5-nitro-phenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 2-hexyl-3-[(2-methoxy-5-nitrophenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 2-hexyl-3-[(2-methoxy-5-nitrophenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 2-hexyl-3-(2-methoxy-5-nitro-benzyl)oxy-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C27H31NO6 MolecularWeight: 465.53814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=C(C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=C(C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C27H31NO6/c1-3-4-5-6-9-18-15-23-21-10-7-8-11-22(21)27(29)34-26(23)16-25(18)33-17-19-14-20(28(30)31)12-13-24(19)32-2/h12-16H,3-11,17H2,1-2H3