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

Systemtic Name: tridecyl 4-[(E)-azanyl-[2,4-bis(oxidanylidene)chromen-3-ylidene]methyl]benzoate Openeye Name: tridecyl 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 tridecyl ester IUPAC Name: tridecyl 4-[(E)-amino-(2,4-dioxochromen-3-ylidene)methyl]benzoate Traditional Name: 4-[(E)-amino-(2,4-diketochroman-3-ylidene)methyl]benzoic acid tridecyl ester Formula: C30H37NO5 MolecularWeight: 491.61848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H37NO5/c1-2-3-4-5-6-7-8-9-10-11-14-21-35-29(33)23-19-17-22(18-20-23)27(31)26-28(32)24-15-12-13-16-25(24)36-30(26)34/h12-13,15-20H,2-11,14,21,31H2,1H3/b27-26+