butyl 4-[3-methanoyl-7-(naphthalen-1-ylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate

Systemtic Name: butyl 4-[3-methanoyl-7-(naphthalen-1-ylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate Openeye Name: butyl 4-[3-formyl-7-(1-naphthylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate CAS Name: 4-[3-formyl-7-(1-naphthalenylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid butyl ester IUPAC Name: butyl 4-[3-formyl-7-(naphthalen-1-ylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate Traditional Name: 4-[3-formyl-7-(1-naphthylmethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid butyl ester Formula: C30H30N2O3 MolecularWeight: 466.5708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C3=C(CCCC3CC4=CC=CC5=CC=CC=C54)C(=N2)C=O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C3=C(CCCC3CC4=CC=CC5=CC=CC=C54)C(=N2)C=O

InChI

InChI=1S/C30H30N2O3/c1-2-3-18-35-30(34)22-14-16-25(17-15-22)32-29-24(11-7-13-27(29)28(20-33)31-32)19-23-10-6-9-21-8-4-5-12-26(21)23/h4-6,8-10,12,14-17,20,24H,2-3,7,11,13,18-19H2,1H3