(phenylmethyl) 2-[7,10-bis(oxidanylidene)-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[7,10-bis(oxidanylidene)-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]ethanoate Openeye Name: benzyl 2-[7,10-dioxo-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]acetate CAS Name: 2-[7,10-dioxo-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[7,10-dioxo-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]acetate Traditional Name: 2-[7,10-diketo-11-phenethyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecan-9-yl]acetic acid benzyl ester Formula: C37H45N3O4 MolecularWeight: 595.7709

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NC(C(=O)N2CCC3=CC=CC=C3)CC(=O)OCC4=CC=CC=C4)CCCCCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC12C(=O)NC(C(=O)N2CCC3=CC=CC=C3)CC(=O)OCC4=CC=CC=C4)CCCCCCC5=CC=CC=C5

InChI

InChI=1S/C37H45N3O4/c41-34(44-29-32-19-11-5-12-20-32)28-33-35(42)40(25-21-31-17-9-4-10-18-31)37(36(43)38-33)22-26-39(27-23-37)24-13-2-1-6-14-30-15-7-3-8-16-30/h3-5,7-12,15-20,33H,1-2,6,13-14,21-29H2,(H,38,43)