4-(2-acetamidoethoxycarbonyl)-2-(2-methylpropylcarbamoylamino)-2-(naphthalen-2-ylmethyl)-6-phenyl-hexanoate

Systemtic Name: 4-(2-acetamidoethoxycarbonyl)-2-(2-methylpropylcarbamoylamino)-2-(naphthalen-2-ylmethyl)-6-phenyl-hexanoate Openeye Name: 4-(2-acetamidoethoxycarbonyl)-2-(isobutylcarbamoylamino)-2-(2-naphthylmethyl)-6-phenyl-hexanoate CAS Name: 4-[2-acetamidoethoxy(oxo)methyl]-2-[[(2-methylpropylamino)-oxomethyl]amino]-2-(2-naphthalenylmethyl)-6-phenylhexanoate IUPAC Name: 4-(2-acetamidoethoxycarbonyl)-2-(2-methylpropylcarbamoylamino)-2-(naphthalen-2-ylmethyl)-6-phenylhexanoate Traditional Name: 4-(2-acetamidoethoxycarbonyl)-2-(isobutylcarbamoylamino)-2-(2-naphthylmethyl)-6-phenyl-hexanoate Formula: C33H40N3O6- MolecularWeight: 574.6872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(CC1=CC2=CC=CC=C2C=C1)(CC(CCC3=CC=CC=C3)C(=O)OCCNC(=O)C)C(=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)NC(CC1=CC2=CC=CC=C2C=C1)(CC(CCC3=CC=CC=C3)C(=O)OCCNC(=O)C)C(=O)[O-]

InChI

InChI=1S/C33H41N3O6/c1-23(2)22-35-32(41)36-33(31(39)40,20-26-14-15-27-11-7-8-12-28(27)19-26)21-29(16-13-25-9-5-4-6-10-25)30(38)42-18-17-34-24(3)37/h4-12,14-15,19,23,29H,13,16-18,20-22H2,1-3H3,(H,34,37)(H,39,40)(H2,35,36,41)/p-1