N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-4-nitro-benzamide

Systemtic Name: N-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-4-nitro-benzamide Openeye Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-4-nitro-benzamide CAS Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-4-nitrobenzamide IUPAC Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-4-nitrobenzamide Traditional Name: N-(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-4-nitro-benzamide Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC2OC(=C1)O

InChI

InChI=1S/C17H16N2O5/c1-10-8-16(20)24-15-9-12(4-7-14(10)15)18-17(21)11-2-5-13(6-3-11)19(22)23/h2-3,5-6,8,15,20H,4,7,9H2,1H3