ethyl (2Z)-4-(1-adamantylcarbonylamino)-2-(phenylmethylidene)butanoate

Systemtic Name: ethyl (2Z)-4-(1-adamantylcarbonylamino)-2-(phenylmethylidene)butanoate Openeye Name: ethyl (2Z)-4-(adamantane-1-carbonylamino)-2-benzylidene-butanoate CAS Name: (2Z)-4-[[1-adamantyl(oxo)methyl]amino]-2-(phenylmethylene)butanoic acid ethyl ester IUPAC Name: ethyl (2Z)-4-(adamantane-1-carbonylamino)-2-benzylidenebutanoate Traditional Name: (Z)-2-[2-(adamantane-1-carbonylamino)ethyl]-3-phenyl-acrylic acid ethyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CC=C1)CCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC=CC=C1)/CCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H31NO3/c1-2-28-22(26)21(13-17-6-4-3-5-7-17)8-9-25-23(27)24-14-18-10-19(15-24)12-20(11-18)16-24/h3-7,13,18-20H,2,8-12,14-16H2,1H3,(H,25,27)/b21-13-