hexadecyl 4-[(E)-azanyl-[2,4-bis(oxidanylidene)chromen-3-ylidene]methyl]benzoate

Systemtic Name: hexadecyl 4-[(E)-azanyl-[2,4-bis(oxidanylidene)chromen-3-ylidene]methyl]benzoate Openeye Name: hexadecyl 4-[(E)-amino-(2,4-dioxochroman-3-ylidene)methyl]benzoate CAS Name: 4-[(E)-amino-(2,4-dioxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]benzoic acid hexadecyl ester IUPAC Name: hexadecyl 4-[(E)-amino-(2,4-dioxochromen-3-ylidene)methyl]benzoate Traditional Name: 4-[(E)-amino-(2,4-diketochroman-3-ylidene)methyl]benzoic acid cetyl ester Formula: C33H43NO5 MolecularWeight: 533.69822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=C2C(=O)C3=CC=CC=C3OC2=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)/C(=C\2/C(=O)C3=CC=CC=C3OC2=O)/N

InChI

InChI=1S/C33H43NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-38-32(36)26-22-20-25(21-23-26)30(34)29-31(35)27-18-15-16-19-28(27)39-33(29)37/h15-16,18-23H,2-14,17,24,34H2,1H3/b30-29+