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

Systemtic Name: (phenylmethyl) 4-naphthalen-1-ylsulfonyl-1,4-diazepane-1-carboxylate Openeye Name: benzyl 4-(1-naphthylsulfonyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(1-naphthalenylsulfonyl)-1,4-diazepane-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-naphthalen-1-ylsulfonyl-1,4-diazepane-1-carboxylate Traditional Name: 4-(1-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=CC=CC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

InChI

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