methyl 4-[(4-tert-butylphenyl)-methyl-carbamoyl]perylene-3-carboxylate

Systemtic Name: methyl 4-[(4-tert-butylphenyl)-methyl-carbamoyl]perylene-3-carboxylate Openeye Name: methyl 4-[(4-tert-butylphenyl)-methyl-carbamoyl]perylene-3-carboxylate CAS Name: 4-[(4-tert-butyl-N-methylanilino)-oxomethyl]-3-perylenecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-tert-butylphenyl)-methylcarbamoyl]perylene-3-carboxylate Traditional Name: 4-[(4-tert-butylphenyl)-methyl-carbamoyl]perylene-3-carboxylic acid methyl ester Formula: C34H29NO3 MolecularWeight: 499.59896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(C)C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=CC=CC6=C5C4=CC=C6)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(C)C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=CC=CC6=C5C4=CC=C6)C(=O)OC

InChI

InChI=1S/C34H29NO3/c1-34(2,3)21-12-14-22(15-13-21)35(4)32(36)27-18-16-25-23-10-6-8-20-9-7-11-24(29(20)23)26-17-19-28(33(37)38-5)31(27)30(25)26/h6-19H,1-5H3