(phenylmethyl) 4-naphthalen-2-ylsulfonyl-1,4-diazepane-1-carboxylate

Systemtic Name: (phenylmethyl) 4-naphthalen-2-ylsulfonyl-1,4-diazepane-1-carboxylate Openeye Name: benzyl 4-(2-naphthylsulfonyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(2-naphthalenylsulfonyl)-1,4-diazepane-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-naphthalen-2-ylsulfonyl-1,4-diazepane-1-carboxylate Traditional Name: 4-(2-naphthylsulfonyl)-1,4-diazepane-1-carboxylic acid benzyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O4S/c26-23(29-18-19-7-2-1-3-8-19)24-13-6-14-25(16-15-24)30(27,28)22-12-11-20-9-4-5-10-21(20)17-22/h1-5,7-12,17H,6,13-16,18H2